Butane

Butane

SCHEMBL2238291

CCCC.COC(=O)CP(=O)(O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
TSHR P16473 4/20 0.42
ENO1 P06733 1/20 0.41
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSD17B10 Q99714 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
MMP2 P08253 5/20 0.37
MMP1 P03956 4/20 0.37
MMP3 P08254 3/20 0.37
MMP9 P14780 2/20 0.37
FDPS P14324 1/20 0.36
MMP8 P22894 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL360260 0.93
Butane SCHEMBL945230 0.79 MGAM (0.48) POLBTSHRENO1MEN1LMNA
Butane SCHEMBL2236998 0.77 TSHR (0.50) TSHRMEN1LMNAKMT2ACA12
Butane SCHEMBL2242033 0.77 ALDH1A1 (0.39) TSHRENO1MEN1LMNAHPGD
Butane SCHEMBL97927 0.76 MEN1 (0.36) TSHRENO1MEN1LMNAHPGD
SCHEMBL13037361 0.75
SCHEMBL27799233 0.74 POLB (0.46) POLBTSHRLMNAKMT2AHSD17B10
SCHEMBL1408938 0.74 ALDH1A1 (0.41) TSHRENO1MEN1LMNAHPGD
Butane SCHEMBL2237628 0.74 NAAA (0.48) TSHRLMNAHPGDTDP1CYP2D6
Butane SCHEMBL11347403 0.74 TSHR (0.34) TSHRENO1MEN1LMNAHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536719-B Synthesis method of high-purity plant source 7-ketolithocholic acid 江苏佳尔科药业集团股份有限公司 2024-02-09 CN claimed
US-20240128511-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2024-04-18 US disclosed
US-11942601-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2024-03-26 US disclosed
CN-114214375-B Process for the preparation of (R) -3- (4-halo-1H-pyrazol-1-yl) -3-cyclopentylpropionate 江苏威凯尔医药科技有限公司 2024-03-19 CN disclosed
CN-115536719-B Synthesis method of high-purity plant source 7-ketolithocholic acid 江苏佳尔科药业集团股份有限公司 2024-02-09 CN disclosed
WO-2023207268-A1 SYNTHESIS METHOD OF PLANT-DERIVED DEOXYCHOLIC ACID 上海科骊科生物技术有限公司 2023-11-02 WO disclosed
CN-116947953-A Synthesis method of plant source deoxycholic acid 上海科骊科生物技术有限公司 2023-10-27 CN disclosed
US-RE49698-E1 Substituted dihydroquinazolines AIC246 AG & CO. KG (DE) 2023-10-17 US disclosed
WO-2023125373-A1 METHOD FOR PREPARING RUXOLITINIB AND INTERMEDIATE THEREOF 江苏威凯尔医药科技有限公司 2023-07-06 WO disclosed
US-11424482-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2022-08-23 US disclosed
US-5807866-A Process for preparing N-benzyl indoles THE UNIVERSITY OF EAST ANGLIA (GB) 1998-09-15 US disclosed
US-5686243-A DETECTING POLYNUCLEOTIDE SEQUENCES; HYBRIDIZATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-11-11 US disclosed
US-5648349-A PHOSPHOLIPASE INHIBITORS MONSANTO COMPANY (US) 1997-07-15 US disclosed
EP-0775694-A2 Process for preparing N-benzyl indoles University of East Anglia (GB) 1997-05-28 EP disclosed
US-5504237-A PLA2 inhibitors MONSANTO COMPANY (US) 1996-04-02 US disclosed
US-5449602-A Polynucleotides AMOCO CORPORATION (US) 1995-09-12 US disclosed
US-5434288-A Phospholipase A2 inhibitor MONSANTO COMPANY (US) 1995-07-18 US disclosed
EP-0324616-B1 Template-directed photoligation AMOCO CORP (US) 1995-03-29 EP disclosed
EP-0324616-A2 Template-directed photoligation AMOCO CORPORATION (US) 1989-07-19 EP disclosed
US-4246103-A INHIBIT PRECIPITATION OF HARD WATER IONS ESPECIALLY FOR INDUSTRIAL WATER AND SLUDGE BAYER AKTIENGESELLSCHAFT (DE) 1981-01-20 US disclosed